SCHEMBL28099985

SCHEMBL28099985

Cc1cn(CC(F)(F)F)c(C(=O)C=O)c1C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27855145 0.78 ALDH1A1 (0.30)
SCHEMBL27934873 0.73 HPGD (0.46)
SCHEMBL20139314 0.71 ALDH1A1 (0.32) PTGDR2
SCHEMBL27889164 0.64 ALDH1A1 (0.40)
SCHEMBL27944075 0.61 SCN5A (0.36)
SCHEMBL28284171 0.61
SCHEMBL27210056 0.59 CYP1A2 (0.46)
SCHEMBL20139328 0.57 HDAC8 (0.32)
SCHEMBL3577728 0.56 CYP1A2 (0.31)
SCHEMBL20709987 0.56 PTGDR2 (0.33) PTGDR2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106029652-B Plant growth regulating compound 先正达参股股份有限公司 2019-08-13 CN disclosed
CN-106029652-A Plant growth regulating compounds 先正达参股股份有限公司 2016-10-12 CN disclosed